SCHEMBL1007227

SCHEMBL1007227

Cc1cc(C(=O)O)c(C(=O)O)c(CC2CO2)c1CC1CO1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 3/20 0.35
MAPT P10636 1/20 0.34
KDM4E B2RXH2 3/20 0.33
ALDH1A1 P00352 3/20 0.33
GAA P10253 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
APEX1 P27695 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
HMGB1 P09429 1/20 0.33
CXCL12 P48061 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
CYP3A4 P08684 1/20 0.32
ACHE P22303 1/20 0.32
ABCC1 P33527 1/20 0.31
LDHA P00338 1/20 0.31
LDHB P07195 1/20 0.31
TTR P02766 1/20 0.31
MAPK1 P28482 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2980272 0.89 NOTUM (0.34) NOTUMMAPTKDM4EALDH1A1GAA
SCHEMBL7727731 0.84 KDM4E (0.32) KDM4EL3MBTL1
SCHEMBL3074823 0.84 NOTUM (0.33) NOTUMMAPTKDM4EAPEX1MEN1
SCHEMBL1007226 0.81 LDHA (0.33) NOTUMMAPTKDM4EAPEX1MEN1
SCHEMBL27915392 0.80 PKM (0.31) NOTUMALDH1A1LDHALDHB
SCHEMBL3076528 0.79 HMGB1 (0.33) ALDH1A1HPGDHSD17B10MEN1KMT2A
SCHEMBL6224428 0.79 CYP1A2 (0.34) ALDH1A1APEX1
SCHEMBL6689310 0.78 HMGB1 (0.31) HMGB1CXCL12
SCHEMBL1644711 0.78
SCHEMBL1376717 0.78 HMGB1 (0.33) NOTUMMAPTKDM4EAPEX1MEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2488585-A1 METHOD FOR CONTINUOUSLY PRODUCING POLYESTER MIXTURES BASF SE (DE) 2012-08-22 EP disclosed
WO-2011045293-A1 METHOD FOR CONTINUOUSLY PRODUCING POLYESTER MIXTURES BASF SE (DE) 2011-04-21 WO disclosed
EP-2268702-A1 METHOD FOR THE CONTINUOUS PRODUCTION OF BIODEGRADABLE POLYESTERS BASF SE (DE) 2011-01-05 EP disclosed
EP-2268704-A1 METHOD FOR THE CONTINUOUS PRODUCTION OF BIODEGRADABLE POLYESTERS BASF SE (DE) 2011-01-05 EP disclosed
WO-2009127555-A1 METHOD FOR THE CONTINUOUS PRODUCTION OF BIODEGRADABLE POLYESTERS BASF SE (DE) 2009-10-22 WO disclosed
WO-2009127556-A1 METHOD FOR THE CONTINUOUS PRODUCTION OF BIODEGRADABLE POLYESTERS BASF SE (DE) 2009-10-22 WO disclosed